⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4868996 | 0.79 | TSHR (0.35) | — | |
| SCHEMBL3753416 | 0.74 | CAMK2A (0.41) | — | |
| SCHEMBL537217 | 0.74 | LMNA (0.48) | — | |
| SCHEMBL9051005 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL455742 | 0.72 | CA12 (0.46) | — | |
| SCHEMBL31662731 | 0.72 | TDP1 (0.35) | — | |
| SCHEMBL6756458 | 0.72 | TDP1 (0.35) | — | |
| SCHEMBL19817170 | 0.70 | CA12 (0.31) | — | |
| SCHEMBL19833104 | 0.70 | ODC1 (0.32) | — | |
| SCHEMBL19615405 | 0.70 | TDP1 (0.32) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100298392-A1 | Isoindoline Derivatives For The Treatment Of Arrhythmias | ASTRAZENECA AB (SE) | 2010-11-25 | — | — | US | disclosed |
| EP-2049484-A1 | ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS | AstraZeneca AB (SE) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008008022-A1 | ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS | ASTRAZENECA AB (SE) | 2008-01-17 | — | — | WO | disclosed |
| US-20080015237-A1 | NEW COMPOUNDS I/418 | ASTRAZENECA AB (SE) | 2008-01-17 | — | — | US | disclosed |